200,000+ products from a single source!
sales@angenechem.com
Home > Pyridines > 1214342-22-9
1214342-22-9 | 2-HYDROXY-5-(PYRIDIN-4-YL)ISONICOTINIC ACID
CAS No: 1214342-22-9 Catalog No: AG01C7GC MDL No:MFCD15477340
Product Description
Catalog Number:
AG01C7GC
Chemical Name:
2-HYDROXY-5-(PYRIDIN-4-YL)ISONICOTINIC ACID
CAS Number:
1214342-22-9
Molecular Formula:
C11H8N2O3
Molecular Weight:
216.1928
MDL Number:
MFCD15477340
IUPAC Name:
2-oxo-5-pyridin-4-yl-1H-pyridine-4-carboxylic acid
InChI:
InChI=1S/C11H8N2O3/c14-10-5-8(11(15)16)9(6-13-10)7-1-3-12-4-2-7/h1-6H,(H,13,14)(H,15,16)
InChI Key:
JVFNFHDZAFRMBX-UHFFFAOYSA-N
SMILES:
Oc1ncc(c(c1)C(=O)O)c1ccncc1
Properties
Complexity:
379
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.053g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
216.196g/mol
Monoisotopic Mass:
216.053g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
79.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4
Related Products
Featured Products
© 2019 Angene International Limited. All rights Reserved.